439095-27-9
Product Name:
3-(3-BROMOPHENYL)-3-(1,1-DIOXO-1LAMBDA6,4-THIAZINAN-4-YL)PROPANOIC ACID
Formula:
C13H16BrNO4S
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COMPUTED DESCRIPTORS
| Molecular Weight | 362.24 g/mol |
|---|---|
| XLogP3 | -1.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 4 |
| Exact Mass | 360.99834 g/mol |
| Monoisotopic Mass | 360.99834 g/mol |
| Topological Polar Surface Area | 83.1 Ų |
| Heavy Atom Count | 20 |
| Formal Charge | 0 |
| Complexity | 434 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |